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6-Methyl-1H-indole

CAT: 0931-TN9332-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-TN9332-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3420-02-8
Target
Others
Related Pathways
Others
Purity
0.9984
Bioactivity
6-Methyl-1H-indole is an indole derivative widely used in biochemical experiments and drug synthesis research.
Smiles
C1=CC=2C=CC(=CC2N1)C
Molecular Formula
C9H9N
Molecular Weight
131.17
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1H-Indole, 6-methyl-

6-Methyl indole is a member of indoles.

CAS Number3420-02-8
PubChem CID137928
IUPAC Name6-methyl-1H-indole
Molecular FormulaC9H9N
Molecular Weight131.17
XLogP3.3
Topological Polar Surface Area15.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity122
SMILES
CC1=CC2=C(C=C1)C=CN2
InChI
InChI=1S/C9H9N/c1-7-2-3-8-4-5-10-9(8)6-7/h2-6,10H,1H3
InChIKey
ONYNOPPOVKYGRS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1H-Indole, 6-methyl-
CAS: 3420-02-8
CID: 137928
Formula: C9H9N
MW: 131.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight131.17
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass131.073499291
Monoisotopic Mass131.073499291
Topological Polar Surface Area15.8 Ų
Heavy Atom Count10
Formal Charge0
Complexity122
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
OR2254-016-Methyl-1H-indole
HY-W016739-01Methyl 1H-indole-6-carboxylate
TRC-M338450-100MGMethyl 6-Methyl-1H-indole-2-carboxylate
JH185242Methyl 3-methyl-1H-indole-6-carboxylate
OR0195-01Methyl 1-methyl-1H-indole-6-carboxylate
OR83074-01Methyl 7-methyl-1H-indole-6-carboxylate
OR88409-01Methyl 6-methyl-1H-indole-5-carboxylate
OR75995-01Methyl 6-methyl-1H-indole-3-carboxylate
OR82524-01Methyl 2-methyl-1H-indole-6-carboxylate
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